2-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]quinazolin-4-amine

Systemtic Name: 2-[[1-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanylmethyl]quinazolin-4-amine Openeye Name: 2-[[1-(p-tolyl)tetrazol-5-yl]sulfanylmethyl]quinazolin-4-amine CAS Name: 2-[[[1-(4-methylphenyl)-5-tetrazolyl]thio]methyl]-4-quinazolinamine IUPAC Name: 2-[[1-(4-methylphenyl)tetrazol-5-yl]sulfanylmethyl]quinazolin-4-amine Traditional Name: [2-[[[1-(p-tolyl)tetrazol-5-yl]thio]methyl]quinazolin-4-yl]amine Formula: C17H15N7S MolecularWeight: 349.4129

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=N2)SCC3=NC4=CC=CC=C4C(=N3)N

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=N2)SCC3=NC4=CC=CC=C4C(=N3)N

InChI

InChI=1S/C17H15N7S/c1-11-6-8-12(9-7-11)24-17(21-22-23-24)25-10-15-19-14-5-3-2-4-13(14)16(18)20-15/h2-9H,10H2,1H3,(H2,18,19,20)